Indole-3-acetate
TL;DR: Indole-3-acetate (CAS 93672-51-6) is a chemical compound with molecular formula C10H8NO2- and molecular weight 174.0555 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(1H-indol-3-yl)acetate
Also Known As: indole-3-acetate, auxin, 3-indoleacetate, indoleacetate, 1H-indol-3-ylacetate
Technical Specifications
| Molecular Formula | C10H8NO2- |
| Molecular Weight | 174.0555 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 55.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.0555 Da |
| Heavy Atoms | 13 |
| Complexity | 200.0 |
| SMILES | C1=CC=C2C(=C1)C(=CN2)CC(=O)[O-] |
| InChIKey | SEOVTRFCIGRIMH-UHFFFAOYSA-M |
Chemical Property Profile of Indole-3-acetate
Property Insights of Indole-3-acetate
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole-3-acetate. With a topological polar surface area (TPSA) of 55.9 Ų, Indole-3-acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole-3-acetate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Indole-3-acetate?
The CAS number of Indole-3-acetate is 93672-51-6.
What is the molecular formula of Indole-3-acetate?
The molecular formula of Indole-3-acetate is C10H8NO2-.
What is the molecular weight of Indole-3-acetate?
The molecular weight of Indole-3-acetate is 174.0555 g/mol.
Where can I buy Indole-3-acetate?
You can request a quote for Indole-3-acetate directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Indole-3-acetate?
Yes, CoreyChem provides custom synthesis services for Indole-3-acetate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.